SCHEMBL33318

SCHEMBL33318

Cc1cc(C)cc(N)c1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
Bromide SCHEMBL22747715 0.96 ALDH1A1 (0.92) —
SCHEMBL178488 0.96 — —
Hydrochloric Acid SCHEMBL27923560 0.96 ALDH1A1 (0.92) —
SCHEMBL29351842 0.96 ALDH1A1 (0.92) —
Fluoride SCHEMBL29374673 0.96 ALDH1A1 (0.92) —
Hydrochloric Acid SCHEMBL2862643 0.96 ALDH1A1 (0.92) —
Iodide SCHEMBL29022389 0.96 ALDH1A1 (0.92) —
SCHEMBL21611339 0.96 ALDH1A1 (0.92) —
Hydrochloric Acid SCHEMBL11823812 0.93 ALDH1A1 (0.86) —
Nitrogen SCHEMBL28448287 0.93 ALDH1A1 (0.86) —

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Appears in 4720 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4696727-A1 STYRENE-FREE REACTIVE SYSTEM AKEMI chemisch technische Spezialfabrik GmbH (DE) 2026-02-18 — — EP claimed
EP-4651870-A1 ONE STEP REACTION FOR THE CATALYTIC SYNTHESIS OF CYCLIC UREA DERIVATIVES Huntsman Petrochemical LLC (US) 2025-11-26 — — EP claimed
CN-120192204-A Preparation method of fluoro aromatic hydrocarbon compound 阜新孚隆宝医药科技有限公司 2025-06-24 — — CN claimed
CN-120118238-A Narrow-band luminous microsphere and preparation method thereof 海南大学 2025-06-10 — — CN claimed
CN-119841825-A Late transition metal catalyst for preparing bimodal UHMWPE, ligand thereof, preparation method and application thereof 璞烯晶新材料(上海)有限公司 2025-04-18 — — CN claimed
CN-119798252-A Method for preparing N-ortho-acyl substituted nitrogen-containing heterocyclic compound and amine-shrinking iron (II) complex thereof 中国石油化工股份有限公司 2025-04-11 — — CN claimed
CN-119528683-A Method for preparing halogenated xylene with high selectivity and halogenated xylene prepared by using same 浙江闰土股份有限公司 2025-02-28 — — CN claimed
CN-118978814-B C.I. pigment red 224 mixed crystal and prefabricated solid, preparation method and application 辽宁鸿港化工有限公司 2025-01-10 — — CN claimed
CN-118724189-B Preparation method of anode material for electrocatalytic degradation of tetracycline sewage 北方工业大学 2024-12-31 — — CN claimed
CN-119143751-A N-ortho-acyl substituted nitrogen-containing heterocyclic compound and preparation method of amine-shrinking iron (II) complex thereof 中国石油化工股份有限公司 2024-12-17 — — CN claimed
EP-0140688-A2 Silane perylene dyes, composite pigments obtainable therefrom, and processes for preparing the same Montedison S.p.A. (IT) 1985-05-08 — — EP claimed
EP-0051806-B1 PROCESS FOR THE PREPARATION OF 3,5-DIMETHYL ANILINE HOECHST AKTIENGESELLSCHAFT (DE) 1984-11-28 — — EP claimed
EP-0051803-B1 PROCESS FOR THE PREPARATION OF 3,5-DIMETHYL ANILINE (SYM. M-XYLIDINE) HOECHST AKTIENGESELLSCHAFT (DE) 1984-04-04 — — EP claimed
US-4405813-A Process for the preparation of 3,5-dimethylaniline HOECHST AKTIENGESELLSCHAFT (DE) 1983-09-20 — — US claimed
US-4375560-A Process for the preparation of 3,5-dimethylaniline (sym. m-xylidine) HOECHST AKTIENGESELLSCHAFT (DE) 1983-03-01 — — US claimed
EP-0023191-B1 MODIFICATION OF PERYLENE-TETRACARBOXYLIC ACID BIS (3,5-DIMETHYLPHENYL) IMIDE, ITS PREPARATION AND USE IN PIGMENTATION CIBA-GEIGY AG (CH) 1983-02-09 — — EP claimed
EP-0051803-A1 Process for the preparation of 3,5-dimethyl aniline (sym. m-xylidine) HOECHST AKTIENGESELLSCHAFT (DE) 1982-05-19 — — EP claimed
EP-0051806-A1 Process for the preparation of 3,5-dimethyl aniline HOECHST AKTIENGESELLSCHAFT (DE) 1982-05-19 — — EP claimed
EP-0023191-A1 Modification of perylene-tetracarboxylic acid bis (3,5-dimethylphenyl) imide, its preparation and use in pigmentation CIBA-GEIGY AG (CH) 1981-01-28 — — EP claimed
US-4174351-A Separation of dissimilar amines UOP INC. (US) 1979-11-13 — — US claimed
Send feedback